Geometry & MOs

Info

ID:	45505
PubChem CID:	10514274
Reduced:	NSiO2C12H23 (1)
Stoich.:	ABC2D12E23 (1)
Weight, g/mol:	241.134575
ΔH_f, kcal/mol:	-129.67
Dipole, Da:	4.23
IP(EA), eV:	-9.11(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[(3-aminophenyl)methyl]piperidin-4-yl]azanium;chloride

Drug info:

PubChemData

Smile

C[C@@H](C(/C=C/C#N)O)O[Si](C)(C)C(C)(C)C

DOS

IR

Vibrations